carbamic acid;iridium

CH3IrNO2 — CID 58983452

IUPACcarbamic acid;iridium
SMILESNC(=O)O.[Ir]
InChIInChI=1S/CH3NO2.Ir/c2-1(3)4;/h2H2,(H,3,4);
InChIKeyPNSGLQKUBWRCMQ-UHFFFAOYSA-N
MW253.26 g/mol
LogP-0.38
Rot. Bonds

About carbamic acid;iridium

carbamic acid;iridium (PubChem CID 58983452) has the molecular formula CH3IrNO2 and a molecular weight of 253.26 g/mol. Its IUPAC name is carbamic acid;iridium.

Molecular Properties

Compound Namecarbamic acid;iridium
PubChem CID58983452
Molecular FormulaCH3IrNO2
Molecular Weight253.26 g/mol
Exact Mass253.98
IUPAC Namecarbamic acid;iridium
SMILESNC(=O)O.[Ir]
InChIInChI=1S/CH3NO2.Ir/c2-1(3)4;/h2H2,(H,3,4);
InChIKeyPNSGLQKUBWRCMQ-UHFFFAOYSA-N
XLogP-0.38
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of carbamic acid;iridium?
The IUPAC name of carbamic acid;iridium (CID 58983452) is carbamic acid;iridium.
What is the SMILES notation for carbamic acid;iridium?
The canonical SMILES for carbamic acid;iridium is NC(=O)O.[Ir].
What is the InChIKey of carbamic acid;iridium?
The InChIKey is PNSGLQKUBWRCMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3NO2.Ir/c2-1(3)4;/h2H2,(H,3,4);.
What are the key properties of carbamic acid;iridium?
carbamic acid;iridium has a molecular weight of 253.26 g/mol, XLogP of -0.38, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbamic acid;iridium is sourced from PubChem (CID 58983452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).